An All-Atom Theory of Electron Transfer at Nanocrystal/Molecule Interfaces: A Hybrid LCAO/DFT Approach
An All-Atom Theory of Electron Transfer at Nanocrystal/Molecule Interfaces: A Hybrid LCAO/DFT Approach
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DOI：
10.1021/acs.jpcc.0c11572
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发表时间：
2021-03
影响因子：
3.7
通讯作者：
A. Kaledin;T. Lian;C. Hill;D. Musaev
中科院分区：
文献类型：
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作者：
A. Kaledin;T. Lian;C. Hill;D. Musaev
界面电子转移（IET）的概率和速率之间的CdSe和CdS纳米晶体的直径为2，4，和6 nm，和蒽醌二聚体（AQ2H+），进行了研究。为了解释...
Interfacial electron transfer (IET) probabilities and rates between CdSe and CdS nanocrystals of diameters 2, 4, and 6 nm, and an anthraquinone dimer (AQ2H+), have been studied. To account for elec...